2-methyl-6-(2-methylpyrazol-3-yl)hexan-3-ol

C11H20N2O — CID 103013814

IUPAC2-methyl-6-(2-methylpyrazol-3-yl)hexan-3-ol
SMILESCC(C)C(O)CCCc1ccnn1C
InChIInChI=1S/C11H20N2O/c1-9(2)11(14)6-4-5-10-7-8-12-13(10)3/h7-9,11,14H,4-6H2,1-3H3
InChIKeyDLPYMHASNFLUJF-UHFFFAOYSA-N
MW196.29 g/mol
LogP1.76
Rot. Bonds5

About 2-methyl-6-(2-methylpyrazol-3-yl)hexan-3-ol

2-methyl-6-(2-methylpyrazol-3-yl)hexan-3-ol (PubChem CID 103013814) has the molecular formula C11H20N2O and a molecular weight of 196.29 g/mol. Its IUPAC name is 2-methyl-6-(2-methylpyrazol-3-yl)hexan-3-ol.

Molecular Properties

Compound Name2-methyl-6-(2-methylpyrazol-3-yl)hexan-3-ol
PubChem CID103013814
Molecular FormulaC11H20N2O
Molecular Weight196.29 g/mol
Exact Mass196.16
IUPAC Name2-methyl-6-(2-methylpyrazol-3-yl)hexan-3-ol
SMILESCC(C)C(O)CCCc1ccnn1C
InChIInChI=1S/C11H20N2O/c1-9(2)11(14)6-4-5-10-7-8-12-13(10)3/h7-9,11,14H,4-6H2,1-3H3
InChIKeyDLPYMHASNFLUJF-UHFFFAOYSA-N
XLogP1.76
TPSA38.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.29
LogP ≤ 51.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2,2-dimethyl-6-(2-methylpyrazol-3-yl)hexan-3-ol
CID 103013811
5-(2-methylpyrazol-3-yl)pentan-2-amine
CID 103004310
4-(aminomethyl)-5-methyl-1-(2-methylpyrazol-3-yl)hexan-3-ol
CID 107443168
1-(2-methylpyrazol-3-yl)hexane-3,4-diol
CID 103454643
4-methoxy-1-(2-methylpyrazol-3-yl)pentan-3-ol
CID 103008347
8-(2-methylpyrazol-3-yl)octan-4-ol
CID 103016003
N,2,2-trimethyl-6-(2-methylpyrazol-3-yl)hexan-3-amine
CID 103004349
1-(2-methylpyrazol-3-yl)pentan-3-ol
CID 64516316
6-(2-methylpyrazol-3-yl)hexane-1,4-diol
CID 106677975
1-(2-methylpyrazol-3-yl)-4-phenylpentan-3-ol
CID 103006232
5-(3-chlorobutyl)-1-methylpyrazole
CID 64514221
5-(3-bromobutyl)-1-methylpyrazole
CID 64509819

Frequently Asked Questions

What is the IUPAC name of 2-methyl-6-(2-methylpyrazol-3-yl)hexan-3-ol?
The IUPAC name of 2-methyl-6-(2-methylpyrazol-3-yl)hexan-3-ol (CID 103013814) is 2-methyl-6-(2-methylpyrazol-3-yl)hexan-3-ol.
What is the SMILES notation for 2-methyl-6-(2-methylpyrazol-3-yl)hexan-3-ol?
The canonical SMILES for 2-methyl-6-(2-methylpyrazol-3-yl)hexan-3-ol is CC(C)C(O)CCCc1ccnn1C.
What is the InChIKey of 2-methyl-6-(2-methylpyrazol-3-yl)hexan-3-ol?
The InChIKey is DLPYMHASNFLUJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2O/c1-9(2)11(14)6-4-5-10-7-8-12-13(10)3/h7-9,11,14H,4-6H2,1-3H3.
What are the key properties of 2-methyl-6-(2-methylpyrazol-3-yl)hexan-3-ol?
2-methyl-6-(2-methylpyrazol-3-yl)hexan-3-ol has a molecular weight of 196.29 g/mol, XLogP of 1.76, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-6-(2-methylpyrazol-3-yl)hexan-3-ol is sourced from PubChem (CID 103013814), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).